Bis(3,5-dibromosalicyl)glutarate
TL;DR: Bis(3,5-dibromosalicyl)glutarate (CAS 75848-75-8) is a chemical compound with molecular formula C19H12Br4O8 and molecular weight 683.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dibromo-2-[5-(2,4-dibromo-6-carboxyphenoxy)-5-oxopentanoyl]oxybenzoic acid
Also Known As: Bis(3,5-dibromosalicyl)glutarate, starbld0014248, Bis(2,4-dibromo-6-carboxyphenyl) pentanedioate, 2,2'-(Glutaroylbis(oxy))bis(3,5-dibromobenzoic acid), Pentanedioic acid,bis(2,4-dibromo-6-carboxyphenyl) ester (9CI)
| Molecular Formula | C19H12Br4O8 |
|---|---|
| Molecular Weight | 683.73 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 683.72656 |
| Heavy Atoms | 31 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 75848-75-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)OC(=O)CCCC(=O)OC2=C(C=C(C=C2Br)Br)C(=O)O)Br)Br |
| InChIKey | WGKPASURHIWGTN-UHFFFAOYSA-N |
Product Overview
Bis(3,5-dibromosalicyl)glutarate (CAS 75848-75-8), with molecular formula C19H12Br4O8 and molecular weight 683.73 g/mol. IUPAC: 3,5-dibromo-2-[5-(2,4-dibromo-6-carboxyphenoxy)-5-oxopentanoyl]oxybenzoic acid.
Chemical Property Profile of Bis(3,5-dibromosalicyl)glutarate
Property Insights of Bis(3,5-dibromosalicyl)glutarate
The XLogP value of 5.2 indicates that Bis(3,5-dibromosalicyl)glutarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(3,5-dibromosalicyl)glutarate. Following Lipinski's Rule of Five, Bis(3,5-dibromosalicyl)glutarate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(3,5-dibromosalicyl)glutarate?
The CAS number of Bis(3,5-dibromosalicyl)glutarate is 75848-75-8.
What is the molecular formula of Bis(3,5-dibromosalicyl)glutarate?
The molecular formula of Bis(3,5-dibromosalicyl)glutarate is C19H12Br4O8.
What is the molecular weight of Bis(3,5-dibromosalicyl)glutarate?
The molecular weight of Bis(3,5-dibromosalicyl)glutarate is 683.73 g/mol.
Where can I buy Bis(3,5-dibromosalicyl)glutarate?
You can request a quote for Bis(3,5-dibromosalicyl)glutarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(3,5-dibromosalicyl)glutarate?
Yes, KEHONG BIO provides custom synthesis services for Bis(3,5-dibromosalicyl)glutarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.